3TOS
Crystal Structure of CalS11, Calicheamicin Methyltransferase
Functional Information from GO Data
Chain | GOid | namespace | contents |
A | 0008171 | molecular_function | O-methyltransferase activity |
B | 0008171 | molecular_function | O-methyltransferase activity |
C | 0008171 | molecular_function | O-methyltransferase activity |
D | 0008171 | molecular_function | O-methyltransferase activity |
E | 0008171 | molecular_function | O-methyltransferase activity |
F | 0008171 | molecular_function | O-methyltransferase activity |
G | 0008171 | molecular_function | O-methyltransferase activity |
H | 0008171 | molecular_function | O-methyltransferase activity |
I | 0008171 | molecular_function | O-methyltransferase activity |
J | 0008171 | molecular_function | O-methyltransferase activity |
Functional Information from PDB Data
site_id | AC1 |
Number of Residues | 24 |
Details | BINDING SITE FOR RESIDUE SAH A 258 |
Chain | Residue |
A | GLU75 |
A | PHE112 |
A | PRO113 |
A | PHE130 |
A | GLY165 |
A | ASP166 |
A | VAL167 |
A | ASP189 |
A | LEU190 |
A | ASP191 |
A | PRO195 |
A | GLY77 |
A | HOH1106 |
A | HOH1651 |
A | HOH1970 |
A | HOH2349 |
D | HOH1165 |
A | VAL78 |
A | ARG79 |
A | ARG82 |
A | HIS83 |
A | ASP107 |
A | THR108 |
A | GLY111 |
site_id | AC2 |
Number of Residues | 14 |
Details | BINDING SITE FOR RESIDUE GLU A 259 |
Chain | Residue |
A | PHE130 |
A | ASP189 |
A | ASP216 |
A | GLU217 |
A | TRP223 |
A | NA260 |
A | HOH267 |
A | HOH595 |
A | HOH2005 |
A | HOH2129 |
A | HOH2409 |
A | HOH2453 |
A | HOH2660 |
A | HOH3771 |
site_id | AC3 |
Number of Residues | 7 |
Details | BINDING SITE FOR RESIDUE NA A 260 |
Chain | Residue |
A | ASP216 |
A | GLU217 |
A | ALA249 |
A | GLU259 |
A | EDO261 |
A | HOH1959 |
A | HOH3075 |
site_id | AC4 |
Number of Residues | 8 |
Details | BINDING SITE FOR RESIDUE EDO A 261 |
Chain | Residue |
A | ASP55 |
A | MSE59 |
A | TYR187 |
A | ASP216 |
A | ALA249 |
A | NA260 |
A | HOH265 |
A | HOH5711 |
site_id | AC5 |
Number of Residues | 23 |
Details | BINDING SITE FOR RESIDUE SAH B 258 |
Chain | Residue |
B | GLU75 |
B | GLY77 |
B | VAL78 |
B | ARG79 |
B | ARG82 |
B | HIS83 |
B | ASP107 |
B | THR108 |
B | GLY111 |
B | PHE112 |
B | PRO113 |
B | GLY165 |
B | ASP166 |
B | VAL167 |
B | ASP189 |
B | LEU190 |
B | ASP191 |
B | PRO195 |
B | HOH455 |
B | HOH1301 |
B | HOH1480 |
B | HOH1779 |
C | HOH1285 |
site_id | AC6 |
Number of Residues | 14 |
Details | BINDING SITE FOR RESIDUE GLU B 259 |
Chain | Residue |
B | PHE130 |
B | ASP189 |
B | ASP216 |
B | GLU217 |
B | LYS222 |
B | TRP223 |
B | NA260 |
B | HOH279 |
B | HOH447 |
B | HOH565 |
B | HOH2512 |
B | HOH2900 |
B | HOH3146 |
B | HOH3241 |
site_id | AC7 |
Number of Residues | 6 |
Details | BINDING SITE FOR RESIDUE NA B 260 |
Chain | Residue |
B | ASP216 |
B | GLU217 |
B | ALA249 |
B | GLU259 |
B | EDO261 |
B | HOH3520 |
site_id | AC8 |
Number of Residues | 8 |
Details | BINDING SITE FOR RESIDUE EDO B 261 |
Chain | Residue |
B | ASP216 |
B | ALA249 |
B | PRO250 |
B | NA260 |
B | HOH544 |
B | ASP55 |
B | MSE59 |
B | TYR187 |
site_id | AC9 |
Number of Residues | 23 |
Details | BINDING SITE FOR RESIDUE SAH C 258 |
Chain | Residue |
B | HOH1581 |
C | GLU75 |
C | GLY77 |
C | VAL78 |
C | ARG79 |
C | ARG82 |
C | HIS83 |
C | ASP107 |
C | THR108 |
C | GLY111 |
C | PHE112 |
C | PRO113 |
C | PHE130 |
C | GLY165 |
C | ASP166 |
C | VAL167 |
C | ASP189 |
C | LEU190 |
C | PRO195 |
C | HOH448 |
C | HOH1132 |
C | HOH1215 |
C | HOH1724 |
site_id | BC1 |
Number of Residues | 15 |
Details | BINDING SITE FOR RESIDUE GLU C 259 |
Chain | Residue |
C | PHE130 |
C | ASP189 |
C | ASP216 |
C | GLU217 |
C | LYS222 |
C | TRP223 |
C | NA260 |
C | EDO261 |
C | HOH526 |
C | HOH570 |
C | HOH596 |
C | HOH761 |
C | HOH2188 |
C | HOH2202 |
C | HOH2976 |
site_id | BC2 |
Number of Residues | 6 |
Details | BINDING SITE FOR RESIDUE NA C 260 |
Chain | Residue |
C | ASP216 |
C | GLU217 |
C | GLU259 |
C | EDO261 |
C | HOH472 |
C | HOH1805 |
site_id | BC3 |
Number of Residues | 7 |
Details | BINDING SITE FOR RESIDUE EDO C 261 |
Chain | Residue |
C | ASP55 |
C | TYR187 |
C | ASP216 |
C | ALA249 |
C | GLU259 |
C | NA260 |
C | HOH4195 |
site_id | BC4 |
Number of Residues | 4 |
Details | BINDING SITE FOR RESIDUE EDO C 262 |
Chain | Residue |
B | THR31 |
C | THR31 |
C | LEU40 |
C | HOH4110 |
site_id | BC5 |
Number of Residues | 24 |
Details | BINDING SITE FOR RESIDUE SAH D 258 |
Chain | Residue |
A | HOH1177 |
D | GLU75 |
D | GLY77 |
D | VAL78 |
D | ARG79 |
D | ARG82 |
D | HIS83 |
D | ASP107 |
D | THR108 |
D | GLY111 |
D | PHE112 |
D | PRO113 |
D | PHE130 |
D | GLY165 |
D | ASP166 |
D | VAL167 |
D | ASP189 |
D | LEU190 |
D | ASP191 |
D | PRO195 |
D | HOH1338 |
D | HOH1532 |
D | HOH1848 |
D | HOH2398 |
site_id | BC6 |
Number of Residues | 13 |
Details | BINDING SITE FOR RESIDUE GLU D 259 |
Chain | Residue |
D | PHE130 |
D | ASP189 |
D | ASP216 |
D | GLU217 |
D | TRP223 |
D | NA260 |
D | HOH614 |
D | HOH2046 |
D | HOH2562 |
D | HOH3290 |
D | HOH3416 |
D | HOH3668 |
D | HOH5957 |
site_id | BC7 |
Number of Residues | 6 |
Details | BINDING SITE FOR RESIDUE NA D 260 |
Chain | Residue |
D | ASP216 |
D | GLU217 |
D | ALA249 |
D | GLU259 |
D | EDO261 |
D | HOH2055 |
site_id | BC8 |
Number of Residues | 7 |
Details | BINDING SITE FOR RESIDUE EDO D 261 |
Chain | Residue |
D | ASP55 |
D | TYR187 |
D | ASP216 |
D | ALA249 |
D | PRO250 |
D | NA260 |
D | HOH272 |
site_id | BC9 |
Number of Residues | 3 |
Details | BINDING SITE FOR RESIDUE EDO D 262 |
Chain | Residue |
A | THR31 |
D | THR31 |
D | HOH5438 |
site_id | CC1 |
Number of Residues | 23 |
Details | BINDING SITE FOR RESIDUE SAH E 258 |
Chain | Residue |
E | GLU75 |
E | GLY77 |
E | VAL78 |
E | ARG79 |
E | ARG82 |
E | HIS83 |
E | ASP107 |
E | THR108 |
E | GLY111 |
E | PHE112 |
E | PRO113 |
E | GLY165 |
E | ASP166 |
E | VAL167 |
E | ASP189 |
E | LEU190 |
E | ASP191 |
E | PRO195 |
E | HOH1344 |
E | HOH1353 |
E | HOH1994 |
E | HOH2371 |
I | HOH1314 |
site_id | CC2 |
Number of Residues | 13 |
Details | BINDING SITE FOR RESIDUE GLU E 259 |
Chain | Residue |
B | SER1 |
E | PHE130 |
E | ASP189 |
E | ASP216 |
E | GLU217 |
E | TRP223 |
E | NA260 |
E | HOH270 |
E | HOH2273 |
E | HOH2595 |
E | HOH3043 |
E | HOH3081 |
E | HOH3571 |
site_id | CC3 |
Number of Residues | 5 |
Details | BINDING SITE FOR RESIDUE NA E 260 |
Chain | Residue |
E | ASP216 |
E | GLU217 |
E | ALA249 |
E | GLU259 |
E | EDO261 |
site_id | CC4 |
Number of Residues | 8 |
Details | BINDING SITE FOR RESIDUE EDO E 261 |
Chain | Residue |
E | ASP55 |
E | MSE59 |
E | TYR187 |
E | ASP216 |
E | ALA249 |
E | PRO250 |
E | NA260 |
E | HOH5185 |
site_id | CC5 |
Number of Residues | 23 |
Details | BINDING SITE FOR RESIDUE SAH F 258 |
Chain | Residue |
F | GLU75 |
F | GLY77 |
F | VAL78 |
F | ARG79 |
F | ARG82 |
F | HIS83 |
F | ASP107 |
F | THR108 |
F | GLY111 |
F | PHE112 |
F | PRO113 |
F | PHE130 |
F | GLY165 |
F | ASP166 |
F | VAL167 |
F | ASP189 |
F | LEU190 |
F | PRO195 |
F | HOH461 |
F | HOH1261 |
F | HOH1355 |
F | HOH1621 |
G | HOH1427 |
site_id | CC6 |
Number of Residues | 13 |
Details | BINDING SITE FOR RESIDUE GLU F 259 |
Chain | Residue |
F | PHE130 |
F | ASP189 |
F | ASP216 |
F | GLU217 |
F | TRP223 |
F | NA260 |
F | HOH268 |
F | HOH503 |
F | HOH504 |
F | HOH2185 |
F | HOH2424 |
F | HOH3753 |
F | HOH3812 |
site_id | CC7 |
Number of Residues | 7 |
Details | BINDING SITE FOR RESIDUE NA F 260 |
Chain | Residue |
F | ASP216 |
F | GLU217 |
F | ALA249 |
F | GLU259 |
F | EDO261 |
F | HOH1850 |
F | HOH3682 |
site_id | CC8 |
Number of Residues | 9 |
Details | BINDING SITE FOR RESIDUE EDO F 261 |
Chain | Residue |
F | ASP55 |
F | MSE59 |
F | TYR187 |
F | ASP216 |
F | ALA249 |
F | PRO250 |
F | NA260 |
F | HOH568 |
F | HOH1457 |
site_id | CC9 |
Number of Residues | 4 |
Details | BINDING SITE FOR RESIDUE EDO F 262 |
Chain | Residue |
F | THR31 |
F | HOH865 |
G | THR31 |
G | LEU40 |
site_id | DC1 |
Number of Residues | 23 |
Details | BINDING SITE FOR RESIDUE SAH G 258 |
Chain | Residue |
F | HOH1149 |
G | GLU75 |
G | GLY77 |
G | VAL78 |
G | ARG79 |
G | ARG82 |
G | HIS83 |
G | ASP107 |
G | THR108 |
G | GLY111 |
G | PHE112 |
G | PRO113 |
G | PHE130 |
G | GLY165 |
G | ASP166 |
G | VAL167 |
G | ASP189 |
G | LEU190 |
G | PRO195 |
G | HOH1182 |
G | HOH1283 |
G | HOH1679 |
G | HOH2125 |
site_id | DC2 |
Number of Residues | 14 |
Details | BINDING SITE FOR RESIDUE GLU G 259 |
Chain | Residue |
G | PHE130 |
G | ASP189 |
G | ASP216 |
G | GLU217 |
G | TRP223 |
G | NA260 |
G | HOH930 |
G | HOH1986 |
G | HOH2581 |
G | HOH3046 |
G | HOH3277 |
G | HOH3701 |
G | HOH3904 |
G | HOH5939 |
site_id | DC3 |
Number of Residues | 7 |
Details | BINDING SITE FOR RESIDUE NA G 260 |
Chain | Residue |
G | ASP216 |
G | GLU217 |
G | ALA249 |
G | GLU259 |
G | EDO261 |
G | HOH876 |
G | HOH1761 |
site_id | DC4 |
Number of Residues | 7 |
Details | BINDING SITE FOR RESIDUE EDO G 261 |
Chain | Residue |
G | ASP55 |
G | TYR187 |
G | ASP216 |
G | ALA249 |
G | NA260 |
G | HOH1654 |
G | HOH3236 |
site_id | DC5 |
Number of Residues | 23 |
Details | BINDING SITE FOR RESIDUE SAH H 258 |
Chain | Residue |
H | GLU75 |
H | GLY77 |
H | VAL78 |
H | ARG79 |
H | ARG82 |
H | HIS83 |
H | ASP107 |
H | THR108 |
H | GLY111 |
H | PHE112 |
H | PRO113 |
H | PHE130 |
H | GLY165 |
H | ASP166 |
H | VAL167 |
H | ASP189 |
H | LEU190 |
H | ASP191 |
H | PRO195 |
H | HOH1541 |
H | HOH1746 |
H | HOH1921 |
J | HOH1589 |
site_id | DC6 |
Number of Residues | 13 |
Details | BINDING SITE FOR RESIDUE GLU H 259 |
Chain | Residue |
H | PHE130 |
H | ASP189 |
H | ASP216 |
H | GLU217 |
H | TRP223 |
H | NA260 |
H | HOH562 |
H | HOH1025 |
H | HOH2077 |
H | HOH2527 |
H | HOH2884 |
H | HOH3276 |
H | HOH3873 |
site_id | DC7 |
Number of Residues | 5 |
Details | BINDING SITE FOR RESIDUE NA H 260 |
Chain | Residue |
H | ASP216 |
H | GLU217 |
H | GLU259 |
H | EDO261 |
H | HOH522 |
site_id | DC8 |
Number of Residues | 7 |
Details | BINDING SITE FOR RESIDUE EDO H 261 |
Chain | Residue |
H | ASP55 |
H | TYR187 |
H | ASP216 |
H | ALA249 |
H | PRO250 |
H | NA260 |
H | HOH1831 |
site_id | DC9 |
Number of Residues | 14 |
Details | BINDING SITE FOR RESIDUE GLU I 258 |
Chain | Residue |
I | PHE130 |
I | ASP189 |
I | ASP216 |
I | GLU217 |
I | TRP223 |
I | NA259 |
I | HOH486 |
I | HOH540 |
I | HOH559 |
I | HOH582 |
I | HOH1895 |
I | HOH2096 |
I | HOH2167 |
I | HOH2367 |
site_id | EC1 |
Number of Residues | 7 |
Details | BINDING SITE FOR RESIDUE NA I 259 |
Chain | Residue |
I | ASP216 |
I | GLU217 |
I | ALA249 |
I | GLU258 |
I | EDO260 |
I | HOH1770 |
I | HOH2780 |
site_id | EC2 |
Number of Residues | 8 |
Details | BINDING SITE FOR RESIDUE EDO I 260 |
Chain | Residue |
I | ASP55 |
I | MSE59 |
I | TYR187 |
I | ASP216 |
I | ALA249 |
I | NA259 |
I | HOH1529 |
I | HOH4255 |
site_id | EC3 |
Number of Residues | 22 |
Details | BINDING SITE FOR RESIDUE SAH I 261 |
Chain | Residue |
E | HOH1115 |
I | GLU75 |
I | GLY77 |
I | VAL78 |
I | ARG79 |
I | ARG82 |
I | HIS83 |
I | ASP107 |
I | THR108 |
I | GLY111 |
I | PHE112 |
I | PRO113 |
I | GLY165 |
I | ASP166 |
I | VAL167 |
I | ASP189 |
I | LEU190 |
I | PRO195 |
I | HOH283 |
I | HOH1109 |
I | HOH1311 |
I | HOH1688 |
site_id | EC4 |
Number of Residues | 2 |
Details | BINDING SITE FOR RESIDUE EDO I 262 |
Chain | Residue |
I | THR31 |
I | HOH5318 |
site_id | EC5 |
Number of Residues | 23 |
Details | BINDING SITE FOR RESIDUE SAH J 258 |
Chain | Residue |
H | HOH1459 |
J | GLU75 |
J | GLY77 |
J | VAL78 |
J | ARG79 |
J | ARG82 |
J | HIS83 |
J | ASP107 |
J | THR108 |
J | GLY111 |
J | PHE112 |
J | PRO113 |
J | GLY165 |
J | ASP166 |
J | VAL167 |
J | ASP189 |
J | LEU190 |
J | ASP191 |
J | PRO195 |
J | HOH1760 |
J | HOH1790 |
J | HOH1870 |
J | HOH2296 |
site_id | EC6 |
Number of Residues | 13 |
Details | BINDING SITE FOR RESIDUE GLU J 259 |
Chain | Residue |
J | PHE130 |
J | ASP189 |
J | ASP216 |
J | GLU217 |
J | TRP223 |
J | NA260 |
J | HOH270 |
J | HOH2174 |
J | HOH2942 |
J | HOH3088 |
J | HOH3279 |
J | HOH3578 |
J | HOH3791 |
site_id | EC7 |
Number of Residues | 7 |
Details | BINDING SITE FOR RESIDUE NA J 260 |
Chain | Residue |
J | ASP216 |
J | GLU217 |
J | ALA249 |
J | GLU259 |
J | EDO262 |
J | HOH1686 |
J | HOH2617 |
site_id | EC8 |
Number of Residues | 5 |
Details | BINDING SITE FOR RESIDUE EDO J 261 |
Chain | Residue |
H | THR31 |
J | LEU30 |
J | THR31 |
J | LEU40 |
J | HOH266 |
site_id | EC9 |
Number of Residues | 7 |
Details | BINDING SITE FOR RESIDUE EDO J 262 |
Chain | Residue |
J | ASP55 |
J | TYR187 |
J | ASP216 |
J | ALA249 |
J | PRO250 |
J | NA260 |
J | HOH1715 |